| CAS Number | 643723-42-6 |
| Catalog Number | AG00JDNV(AGN-PC-0WBK9Z) |
| Chemical Name | ([4-(4-Chlorophenyl)-1,3-thiazol-2-yl]methyl)amine dihydrochloride |
| IUPAC Name | [4-(4-chlorophenyl)-1,3-thiazol-2-yl]methanamine |
| InChI | InChI=1S/C10H9ClN2S/c11-8-3-1-7(2-4-8)9-6-14-10(5-12)13-9/h1-4,6H,5,12H2 |
| InChI Key | DSXWLWCFGZLTAR-UHFFFAOYSA-N |
| MDL Number | MFCD05221835 |
| Molecular Formula | C10H9ClN2S |
| Molecular Weight | 224.7099 |
| SMILES | NCC1SC=C(C2=CC=C(Cl)C=C2)N=1 |
| Synonyms | [4-(4-chlorophenyl)-1,3-thiazol-2-yl]methanamine,
[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methylamine,
643723-42-6,
{[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methyl}amine dihydrochloride,
AC1MN9KR,
AC1Q543Q,
SCHEMBL16217967,
CTK8F2490,
ALBB-016018,
ZINC3709633,
AKOS000210097,
MCULE-9158569756,
NE57301,
T4909,
EN300-40815,
1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methanamine dihydrochloride,
CID3299475,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.706g/mol |
| Monoisotopic Mass | 224.017g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number